Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB0CU6
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| Ligand Name |
(2R,3S,4R)-3-(4-hydroxyphenyl)-4-methyl-2-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1-benzopyran-7-ol
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| Synonyms |
(2R,3S,4R)-3-(4-hydroxyphenyl)-4-methyl-2-{4-[2-(pyrrolidin-1-yl)ethoxy]phenyl}-3,4-dihydro-2H-1-benzopyran-7-ol; 85M
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| Structure |
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Download2D MOL |
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| Formula |
C28H31NO4
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| Canonical SMILES |
CC1C(C(OC2=C1C=CC(=C2)O)C3=CC=C(C=C3)OCCN4CCCC4)C5=CC=C(C=C5)O
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| InChI |
1S/C28H31NO4/c1-19-25-13-10-23(31)18-26(25)33-28(27(19)20-4-8-22(30)9-5-20)21-6-11-24(12-7-21)32-17-16-29-14-2-3-15-29/h4-13,18-19,27-28,30-31H,2-3,14-17H2,1H3/t19-,27-,28-/m0/s1
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| InChIKey |
DAXBQRCWNLRGAD-MDZDMXMASA-N
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| PubChem Compound ID | ||||
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